[1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol

C17H23N3O — CID 110898884

IUPAC[1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol
SMILESOCC1CCCCN1Cc1nccn1Cc1ccccc1
InChIInChI=1S/C17H23N3O/c21-14-16-8-4-5-10-19(16)13-17-18-9-11-20(17)12-15-6-2-1-3-7-15/h1-3,6-7,9,11,16,21H,4-5,8,10,12-14H2
InChIKeyVXNMKJRPZWUJEM-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.28
Rot. Bonds5

About [1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol

[1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol (PubChem CID 110898884) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is [1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol
PubChem CID110898884
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name[1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol
SMILESOCC1CCCCN1Cc1nccn1Cc1ccccc1
InChIInChI=1S/C17H23N3O/c21-14-16-8-4-5-10-19(16)13-17-18-9-11-20(17)12-15-6-2-1-3-7-15/h1-3,6-7,9,11,16,21H,4-5,8,10,12-14H2
InChIKeyVXNMKJRPZWUJEM-UHFFFAOYSA-N
XLogP2.28
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[(4-phenylmethoxyphenyl)methyl]piperidin-2-yl]methanol
CID 23961585
1-benzyl-2-[[(2R)-2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazole
CID 95609576
1-[(1-benzylimidazol-2-yl)methyl]piperidin-4-ol
CID 110887635
[1-[[1-(difluoromethyl)imidazol-2-yl]methyl]azepan-2-yl]methanol
CID 116637538
[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]methanol
CID 94336697
[1-(pyridin-4-ylmethyl)azepan-2-yl]methanol
CID 116637584
(9aR)-2-[(1-benzylimidazol-2-yl)methyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 124607255
1-methyl-2-[[(2S)-2-(2-phenylethyl)pyrrolidin-1-yl]methyl]imidazole
CID 95595150
[(2R)-1-(2-phenylethyl)piperidin-2-yl]methanol
CID 26457952
4-[(2R)-1-[(1-benzylimidazol-2-yl)methyl]pyrrolidin-2-yl]-1,3,5-trimethylpyrazole
CID 95750793
5-[1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]-3-(2-methoxyethyl)-1,2,4-oxadiazole
CID 134700016
N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine
CID 24715628

Frequently Asked Questions

What is the IUPAC name of [1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol?
The IUPAC name of [1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol (CID 110898884) is [1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol.
What is the SMILES notation for [1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol?
The canonical SMILES for [1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol is OCC1CCCCN1Cc1nccn1Cc1ccccc1.
What is the InChIKey of [1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol?
The InChIKey is VXNMKJRPZWUJEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c21-14-16-8-4-5-10-19(16)13-17-18-9-11-20(17)12-15-6-2-1-3-7-15/h1-3,6-7,9,11,16,21H,4-5,8,10,12-14H2.
What are the key properties of [1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol?
[1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol has a molecular weight of 285.39 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-benzylimidazol-2-yl)methyl]piperidin-2-yl]methanol is sourced from PubChem (CID 110898884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).